Vitas-M small molecule compound

4-({[(2Z)-3-[2-(4-methoxyphenyl)ethyl]-4-oxo-2-(phenylimino)-1,3-thiazinan-6-yl]carbonyl}amino)benzoic acid

Catalog ID
STK051501
SMILES COc1ccc(cc1)CCN1C(=O)CC(S/C/1=N\c1ccccc1)C(=O)Nc1ccc(cc1)C(=O)O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C27H25N3O5S MW 503.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O5S/c1-35-22-13-7-18(8-14-22)15-16-30-24(31)17-23(36-27(30)29-20-5-3-2-4-6-20)25(32)28-21-11-9-19(10-12-21)26(33)34/h2-14,23H,15-17H2,1H3,(H,28,32)(H,33,34)/b29-27-
InChIKey
XONYMNPYPUFZKJ-OHYPFYFLSA-N
Synonyms
442536-77-8
(Z)4(3(4methoxyphenethyl)4oxo2(phenylimino)13thiazinane6carboxamido)benzoicacid
4((((2Z)3(2(4methoxyphenyl)ethyl)4oxo2(phenylimino)13thiazinan6yl)carbonyl)amino)benzoicacid
442536778
COc1ccc(cc1)CCN1C(=O)CC(SC1=Nc1ccccc1)C(=O)Nc1ccc(cc1)C(=O)O
MFCD02144031
STK051501
ZINC000013403420
ZINC000013403425

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Available files

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